Compounds
| ID | Spectrum Quality | Annotated Name |
|---|
COMPOUND NPA028784
PROPERTIES
| NPAID | NPA028784 |
|---|---|
| CLUSTER ID | 415 |
| NODE ID | 374 |
| NAME | Anabaenopeptin 850 |
| FORMULA | C43H63N9O9 |
| MOLECULAR WEIGHT (Da) | 850.0310 |
| ACCURATE MASS (Da) | 849.4749 |
| ORIGIN ORGANISM TYPE | Bacterium |
| ORIGIN GENUS | Unknown |
| ORIGIN SPECIES | sp. |
| InChIKey | PKSSHNFKYXYKNH-UHFFFAOYSA-N |
| InChI | InChI=1S/C43H63N9O9/c1-4-27(2)36-40(57)47-31(22-21-28-15-7-5-8-16-28)41(58)52(3)34(26-35(45)53)39(56)48-33(25-29-17-9-6-10-18-29)37(54)46-24-14-12-19-30(38(55)51-36)49-43(61)50-32(42(59)60)20-11-13-23-44/h5-10,15-18,27,30-34,36H,4,11-14,19-26,44H2,1-3H3,(H2,45,53)(H,46,54)(H,47,57)(H,48,56)(H,51,55)(H,59,60)(H2,49,50,61) |
| SMILES | CCC(C)C1NC(=O)C(NC(=O)NC(CCCCN)C(=O)O)CCCCNC(=O)C(CC2=CC=CC=C2)NC(=O)C(CC(N)=O)N(C)C(=O)C(CCC2=CC=CC=C2)NC1=O |
ORIGINAL ISOLATION REFERENCE
| CITATION | Sanz M; Andreote AP; Fiore MF; Dörr FA; Pinto E Structural Characterization of New Peptide Variants Produced by Cyanobacteria from the Brazilian Atlantic Coastal Forest Using Liquid Chromatography Coupled to Quadrupole Time-of-Flight Tandem Mass Spectrometry. Marine Drugs 2015 13 (6) 3892-3919. | ||
|---|---|---|---|
| DOI | 10.3390/md13063892 | PMID | 26096276 |
